%chk=000082750.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082750

0 1
 O    2.333400      0.4809000      -1.238300    
 N   -2.103100      6.4999998E-02 -0.1333000    
 N    1.464100     -0.8798000      0.4301000    
 C  -0.7562000      0.1505000      0.4299000    
 C   -2.933800       1.163100      0.3594000    
 C   -2.712900      -1.223600      0.1930000    
 C   0.1155000     -0.9755000     -0.1180000    
 C   -2.315100       2.510700      2.8899999E-02
 C   -4.089600      -1.354500     -0.4359000    
 C    2.452200     -0.1511000     -0.1935000    
 C    3.732000     -0.2162000      0.5615000    
 C    4.813600      0.4305000      0.1162000    
 H  -0.7743000      0.1129000       1.527600    
 H  -0.2641000       1.087200      0.1472000    
 H   -3.911400       1.157800     -0.1335000    
 H   -3.107500       1.093500       1.440700    
 H   -2.143700      -2.053300     -0.2341000    
 H   -2.779900      -1.386600       1.275900    
 H   0.1689000     -0.9423000      -1.212100    
 H  -0.2183000      -1.968500      0.1909000    
 H   -1.468100       2.754100      0.6778000    
 H   -1.994000       2.567000      -1.017000    
 H   -3.058700       3.301200      0.1826000    
 H   -4.845100     -0.7557000      8.2199998E-02
 H   -4.080700      -1.077600      -1.495800    
 H   -4.424000      -2.396600     -0.3746000    
 H    1.654100      -1.366300       1.301500    
 H    3.780700     -0.7934000       1.478400    
 H    5.743700      0.3785000      0.6725000    
 H    4.808900       1.018800     -0.7946000    


%chk=000082750-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000082750

0 1
O 2.068457 1.210202 -0.418771
N -2.144359 -0.047797 0.186683
N 1.539252 -1.012789 0.027721
C -0.747214 -0.170360 0.659747
C -2.743182 1.291413 0.425249
C -3.003782 -1.186365 0.597471
C 0.138860 -0.868335 -0.405955
C -2.167394 2.369889 -0.513062
C -4.194158 -1.425059 -0.352147
C 2.422803 0.058265 -0.008105
C 3.809810 -0.260747 0.464167
C 4.782225 0.685327 0.478264
H -0.679194 -0.725796 1.625421
H -0.321334 0.832565 0.834278
H -3.831729 1.212295 0.250180
H -2.615934 1.611213 1.490801
H -2.371512 -2.095326 0.599948
H -3.378042 -1.062804 1.646660
H 0.112300 -0.254071 -1.322260
H -0.262871 -1.869130 -0.647430
H -1.072268 2.467734 -0.402286
H -2.377146 2.109612 -1.565293
H -2.619499 3.355405 -0.293417
H -4.883100 -0.561615 -0.374801
H -3.830074 -1.595112 -1.380431
H -4.776705 -2.307960 -0.028224
H 1.862251 -1.912414 0.386186
H 4.019622 -1.287312 0.797978
H 5.800262 0.467785 0.817622
H 4.550255 1.701987 0.139406


